Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "75618067b0bfb4e9df58de85c9699106",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 110.074,
"b": 110.074,
"c": 57.728,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.8],
"number_observations_unique": 36948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 30.43
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.9990000000000001
}
]
},
"refln_shells": [
{
"resolution_limits": [1.91,1.80],
"number_observations_unique": 5811,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.387
},
{
"type": "R(meas)",
"value": 0.401
},
{
"type": "CC(1/2)",
"value": 0.97
}
]
},
{
"resolution_limits": [2.04,1.91],
"number_observations_unique": 5537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.22399999999999998
},
{
"type": "R(meas)",
"value": 0.233
},
{
"type": "CC(1/2)",
"value": 0.9890000000000001
}
]
},
{
"resolution_limits": [2.21,2.04],
"number_observations_unique": 5186,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.13
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.42,2.21],
"number_observations_unique": 4781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.08800000000000001
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [2.7,2.42],
"number_observations_unique": 4367,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.12,2.70],
"number_observations_unique": 3867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05
},
{
"type": "R(meas)",
"value": 0.052000000000000005
},
{
"type": "CC(1/2)",
"value": 0.9990000000000001
}
]
},
{
"resolution_limits": [3.81,3.12],
"number_observations_unique": 3294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "CC(1/2)",
"value": 0.9990000000000001
}
]
},
{
"resolution_limits": [5.38,3.81],
"number_observations_unique": 2602,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.040999999999999995
},
{
"type": "CC(1/2)",
"value": 0.9990000000000001
}
]
}
]
}